ChemSpider 2D Image | 4-([1,2,4]Triazolo[4,3-b]pyridazin-6-yloxy)benzoic acid | C12H8N4O3

4-([1,2,4]Triazolo[4,3-b]pyridazin-6-yloxy)benzoic acid

  • Molecular FormulaC12H8N4O3
  • Average mass256.217 Da
  • Monoisotopic mass256.059631 Da
  • ChemSpider ID24600428

More details:

Validated by Experts, Validated by Users, Non-Validated, Removed by Users

4-([1,2,4]Triazolo[4,3-b]pyridazin-6-yloxy)benzoesäure [German] [ACD/IUPAC Name]
4-([1,2,4]Triazolo[4,3-b]pyridazin-6-yloxy)benzoic acid [ACD/IUPAC Name]
Acide 4-([1,2,4]triazolo[4,3-b]pyridazin-6-yloxy)benzoïque [French] [ACD/IUPAC Name]
Benzoic acid, 4-(1,2,4-triazolo[4,3-b]pyridazin-6-yloxy)- [ACD/Index Name]
1219546-90-3 [RN]
4-([1,2,4]Triazolo[4,3-b]pyridazin-6-yloxy)-benzoic acid
4-{[1,2,4]triazolo[4,3-b]pyridazin-6-yloxy}benzoic acid
MFCD16090092 [MDL number]
VS-11388

    Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

    Density: 1.5±0.1 g/cm3
    Boiling Point:
    Vapour Pressure:
    Enthalpy of Vaporization:
    Flash Point:
    Index of Refraction: 1.731
    Molar Refractivity: 66.4±0.5 cm3
    #H bond acceptors: 7
    #H bond donors: 1
    #Freely Rotating Bonds: 3
    #Rule of 5 Violations: 0
    ACD/LogP: 0.92
    ACD/LogD (pH 5.5): -0.16
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 3.84
    ACD/LogD (pH 7.4): -1.59
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.00
    Polar Surface Area: 90 Å2
    Polarizability: 26.3±0.5 10-24cm3
    Surface Tension: 67.8±7.0 dyne/cm
    Molar Volume: 166.3±7.0 cm3

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